Geometry & MOs

Info

ID:	244418
PubChem CID:	99350783
Reduced:	N4O4C23H32 (1)
Stoich.:	A4B4C23D32 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-162.43
Dipole, Da:	2.42
IP(EA), eV:	-7.82(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3R)-1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-pyrrol-1-ylbenzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CC[C@@H](C2)CNC(=O)CCCN3C(=O)C4(CCCC4)NC3=O

DOS

IR

Vibrations