Geometry & MOs

Info

ID:	374464
PubChem CID:	131329798
Reduced:	NOC11H11 (1)
Stoich.:	ABC11D11 (1)
Weight, g/mol:	174.079313
ΔH_f, kcal/mol:	10.07
Dipole, Da:	5.0
IP(EA), eV:	-9.35(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2-hydroxyanilino)but-2-enenitrile

Drug info:

PubChemData

Smile

CC/C(=C/C#N)/C1=CC=CC=C1O

DOS

IR

Vibrations