Geometry & MOs

Info

ID:	166084
PubChem CID:	74635173
Reduced:	FNO7H20C25 (1)
Stoich.:	ABC7D20E25 (1)
Weight, g/mol:	329.081871
ΔH_f, kcal/mol:	-215.82
Dipole, Da:	8.37
IP(EA), eV:	-9.5(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2-chlorophenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CC=CO3)C4=CC=C(C=C4)C(=O)OC)O)F

DOS

IR

Vibrations