Geometry & MOs

Info

ID:	345596
PubChem CID:	127269896
Reduced:	ON2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	-86.66
Dipole, Da:	6.67
IP(EA), eV:	-8.84(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations