Geometry & MOs

Info

ID:	244424
PubChem CID:	99350802
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	384.204907
ΔH_f, kcal/mol:	-97.66
Dipole, Da:	2.94
IP(EA), eV:	-8.02(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyphenyl)-N-[[(3S)-1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CC[C@H](C2)CNC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations