Geometry & MOs

Info

ID:	201606
PubChem CID:	79562474
Reduced:	N3C17H29 (1)
Stoich.:	A3B17C29 (1)
Weight, g/mol:	252.044774
ΔH_f, kcal/mol:	3.48
Dipole, Da:	3.86
IP(EA), eV:	-8.59(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(chloromethyl)-1-(2-methyl-2-methylsulfonylpropyl)tetrazole

Drug info:

PubChemData

Smile

CCNC(C)C1=C(N(N=C1C)CC2CC3CCC2C3)C

DOS

IR

Vibrations