Geometry & MOs

Info

ID:	60850
PubChem CID:	26702625
Reduced:	NO3H9C11 (2)
Stoich.:	AB3C9D11 (2)
Weight, g/mol:	361.131408
ΔH_f, kcal/mol:	-93.82
Dipole, Da:	4.21
IP(EA), eV:	-8.86(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-benzamidophenyl) 3-methoxy-4-methylbenzoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC

DOS

IR

Vibrations