Geometry & MOs

Info

ID:	180530
PubChem CID:	76649074
Reduced:	N2O3C16H18 (1)
Stoich.:	A2B3C16D18 (1)
Weight, g/mol:	311.152144
ΔH_f, kcal/mol:	-82.19
Dipole, Da:	4.6
IP(EA), eV:	-10.06(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-naphthalen-2-yl-3-(pent-4-enoylamino)butanoic acid

Drug info:

PubChemData

Smile

C=CCCC(=O)NC(CC1=CC=C(C=C1)C#N)CC(=O)O

DOS

IR

Vibrations