Geometry & MOs

Info

ID:	228912
PubChem CID:	87566194
Reduced:	NSO4C16H25 (1)
Stoich.:	ABC4D16E25 (1)
Weight, g/mol:	315.071602
ΔH_f, kcal/mol:	-171.64
Dipole, Da:	10.07
IP(EA), eV:	-9.62(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzotriazol-1-yl)-1-(2,4-dinitrophenyl)hydrazine

Drug info:

PubChemData

Smile

CCC(C)[NH+]1CCC(=O)CC1.CC1=CC=C(C=C1)S(=O)(=O)[O-]

DOS

IR

Vibrations