Geometry & MOs

Info

ID:	238277
PubChem CID:	92729933
Reduced:	N3O4C18H25 (1)
Stoich.:	A3B4C18D25 (1)
Weight, g/mol:	409.200156
ΔH_f, kcal/mol:	-166.96
Dipole, Da:	7.09
IP(EA), eV:	-9.22(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(4-benzamidobenzoyl)-N-(3-methoxypropyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCC[C@@H]2C(=O)NCCCOC

DOS

IR

Vibrations