Geometry & MOs

Info

ID:	249070
PubChem CID:	103086622
Reduced:	SN5C10H19 (1)
Stoich.:	AB5C10D19 (1)
Weight, g/mol:	283.183067
ΔH_f, kcal/mol:	51.88
Dipole, Da:	5.07
IP(EA), eV:	-8.93(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[1-[1-(thian-2-ylmethyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1CC2CCCS2

DOS

IR

Vibrations