Geometry & MOs

Info

ID:	156623
PubChem CID:	56371391
Reduced:	F2O2N3C20H29 (1)
Stoich.:	A2B2C3D20E29 (1)
Weight, g/mol:	424.202989
ΔH_f, kcal/mol:	-169.23
Dipole, Da:	1.49
IP(EA), eV:	-8.76(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2,6-diethylphenyl)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=CC=C1F)F)N2CCC(CC2)CCN3CCOCC3

DOS

IR

Vibrations