Geometry & MOs

Info

ID:	124200
PubChem CID:	50874550
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	388.178693
ΔH_f, kcal/mol:	-24.76
Dipole, Da:	4.8
IP(EA), eV:	-9.02(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-methyl-3-[[4-(N-methylanilino)benzoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)N(C)CC2=NC(=NO2)C3=CC(=CC=C3)OC

DOS

IR

Vibrations