Geometry & MOs

Info

ID:	121082
PubChem CID:	50755266
Reduced:	FN3O3C19H22 (1)
Stoich.:	AB3C3D19E22 (1)
Weight, g/mol:	397.119319
ΔH_f, kcal/mol:	-153.72
Dipole, Da:	2.88
IP(EA), eV:	-9.39(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(2-chlorophenyl)methyl]-2,6-dioxopyrimidin-1-yl]-N-[(4-methylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CN2C(=O)C=CN(C2=O)CC3=CC=C(C=C3)F

DOS

IR

Vibrations