Geometry & MOs

Info

ID:

300446

PubChem CID:

121283285

Reduced:

OF3N4C27H35 (1)

Stoich.:

AB3C4D27E35 (1)

Weight, g/mol:

516.232381

ΔHf, kcal/mol:

-143.68

Dipole, Da:

5.28

IP(EA), eV:

 -8.43(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-2-[[2-(2,2,2-trifluoroethyl)-3,4-dihydro-1H-isoquinolin-8-yl]amino]-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CC1C2=C(CCN1CC3CC3)C(=CC=C2)NCC(=O)N(CCNC)CC4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations