Geometry & MOs

Info

ID:	429576
PubChem CID:	135169625
Reduced:	O2N5H33C56 (1)
Stoich.:	A2B5C33D56 (1)
Weight, g/mol:	164.106196
ΔH_f, kcal/mol:	246.11
Dipole, Da:	3.67
IP(EA), eV:	-8.1(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-2-amino-1-hydrazinylethenyl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC4=C(C=C3)C5=CC=CC=C5O4)C6=CC=CC(=C6)C7=CC(=CC=C7)N8C9=CC1=CC=CC=C1C=C9C1=C8C2=C(C=C1)N=C(O2)C1=CC=CC=C1

DOS

IR

Vibrations