Geometry & MOs

Info

ID:	393800
PubChem CID:	135021715
Reduced:	O2N6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	310.190595
ΔH_f, kcal/mol:	68.73
Dipole, Da:	4.49
IP(EA), eV:	-9.95(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-cyclohexyltetrazol-5-yl)-2-propylindazole

Drug info:

PubChemData

Smile

CCCNC(C1=CC=CC=C1[N+](=O)[O-])C2=NN=NN2C3CCCCC3

DOS

IR

Vibrations