Geometry & MOs

Info

ID:	194561
PubChem CID:	78556439
Reduced:	N2O7H18C19 (1)
Stoich.:	A2B7C18D19 (1)
Weight, g/mol:	375.08735
ΔH_f, kcal/mol:	-152.98
Dipole, Da:	3.6
IP(EA), eV:	-8.88(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-chloro-4-methoxyanilino)-2-oxoethyl] 3-(4-methoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)C2COC3=CC=CC=C3O2)C

DOS

IR

Vibrations