Geometry & MOs

Info

ID:	304560
PubChem CID:	124756286
Reduced:	ClO2N3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-62.43
Dipole, Da:	3.25
IP(EA), eV:	-9.73(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamidophenyl)-2-[(3S)-3-methoxypyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC[C@H]1C(=O)N(CCN1C(=O)C2=CC(=CN=C2)Cl)C

DOS

IR

Vibrations