Geometry & MOs

Info

ID:	342505
PubChem CID:	127265660
Reduced:	NO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-155.28
Dipole, Da:	7.7
IP(EA), eV:	-9.93(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-cyclopropylbut-2-enoylamino)phenyl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC=C(C)C(=O)NCC(CC(C)C)C(=O)O

DOS

IR

Vibrations