Geometry & MOs

Info

ID:	211106
PubChem CID:	80897284
Reduced:	SN5C12H17 (1)
Stoich.:	AB5C12D17 (1)
Weight, g/mol:	276.133474
ΔH_f, kcal/mol:	68.18
Dipole, Da:	5.16
IP(EA), eV:	-8.7(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydrazinyl-N-(1-imidazol-1-ylpropan-2-yl)-5-nitroaniline

Drug info:

PubChemData

Smile

CCC(C1=CC=CS1)NC2=NC(=NC=C2C)NN

DOS

IR

Vibrations