Geometry & MOs

Info

ID:	24963
PubChem CID:	615228
Reduced:	O2N3H11C12 (1)
Stoich.:	A2B3C11D12 (1)
Weight, g/mol:	229.085127
ΔH_f, kcal/mol:	-8.39
Dipole, Da:	3.27
IP(EA), eV:	-9.12(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-3-(1H-imidazol-5-yl)prop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=CC2=CN=CN2)C(=O)O

DOS

IR

Vibrations