Geometry & MOs

Info

ID:	333070
PubChem CID:	127251494
Reduced:	N3O3C22H27 (1)
Stoich.:	A3B3C22D27 (1)
Weight, g/mol:	385.18017
ΔH_f, kcal/mol:	-104.9
Dipole, Da:	2.14
IP(EA), eV:	-9.13(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[4-[(4-fluorophenyl)methyl]-6-methylpyridin-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2=CC(=NC(=C2)C)C3CN(CCO3)C(=O)CNC(=O)C

DOS

IR

Vibrations