Geometry & MOs

Info

ID:	171660
PubChem CID:	75410995
Reduced:	O3N4C18H18 (1)
Stoich.:	A3B4C18D18 (1)
Weight, g/mol:	361.200156
ΔH_f, kcal/mol:	-35.65
Dipole, Da:	5.37
IP(EA), eV:	-8.77(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N=C3N2[C@H](COC3)CNC(=O)C4=CN=CC=C4

DOS

IR

Vibrations