Geometry & MOs

Info

ID:	422128
PubChem CID:	135117258
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	326.210661
ΔH_f, kcal/mol:	7.97
Dipole, Da:	0.76
IP(EA), eV:	-8.26(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2,3-dihydro-1H-indene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(N=C1N2CCC(CC2)OCC3=CC=CC=N3)N4CCCC4)C

DOS

IR

Vibrations