Geometry & MOs

Info

ID:	165571
PubChem CID:	74568305
Reduced:	NO2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	284.079707
ΔH_f, kcal/mol:	-145.78
Dipole, Da:	3.42
IP(EA), eV:	-9.5(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(naphthalen-1-ylcarbamoylamino)-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

CCC1=CC=CC(=C1NC(=O)NC(=O)C=CC(=O)O)C

DOS

IR

Vibrations