Geometry & MOs

Info

ID:	249015
PubChem CID:	103086230
Reduced:	SN5C9H19 (1)
Stoich.:	AB5C9D19 (1)
Weight, g/mol:	265.226646
ΔH_f, kcal/mol:	54.91
Dipole, Da:	8.37
IP(EA), eV:	-8.82(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(1-cyclopropylbutan-2-yl)tetrazol-5-yl]ethyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1CCCSC

DOS

IR

Vibrations