Geometry & MOs

Info

ID:	31645
PubChem CID:	855974
Reduced:	OSN3C18H19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	260.102174
ΔH_f, kcal/mol:	47.91
Dipole, Da:	4.46
IP(EA), eV:	-8.45(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-acetyl-2-(5-phenyltetrazol-2-yl)acetohydrazide

Drug info:

PubChemData

Smile

CC(C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations