Geometry & MOs

Info

ID:	249058
PubChem CID:	103086540
Reduced:	N7C10H17 (1)
Stoich.:	A7B10C17 (1)
Weight, g/mol:	251.210996
ΔH_f, kcal/mol:	108.08
Dipole, Da:	8.46
IP(EA), eV:	-9.28(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(2,2-dimethylcyclopentyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C)C1=NN=NN1C2=NN(C=C2)C

DOS

IR

Vibrations