Geometry & MOs

Info

ID:	248894
PubChem CID:	103085337
Reduced:	N5C16H27 (1)
Stoich.:	A5B16C27 (1)
Weight, g/mol:	273.125946
ΔH_f, kcal/mol:	30.2
Dipole, Da:	7.06
IP(EA), eV:	-9.78(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(1,1-dioxothiolan-3-yl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C(C)C23CC4CC(C2)CC(C4)C3)NC

DOS

IR

Vibrations