Geometry & MOs

Info

ID:	159837
PubChem CID:	57288804
Reduced:	ON2C11H24 (1)
Stoich.:	AB2C11D24 (1)
Weight, g/mol:	611.246331
ΔH_f, kcal/mol:	-79.67
Dipole, Da:	3.07
IP(EA), eV:	-9.39(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[acetyl-[(2-chlorophenyl)methyl]amino]-3-(1H-indol-3-yl)propan-2-yl]-2-[4-(5-fluoro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCCCCC(=O)CCCCC(N)N

DOS

IR

Vibrations