Geometry & MOs

Info

ID:	249057
PubChem CID:	103086538
Reduced:	N7C9H15 (1)
Stoich.:	A7B9C15 (1)
Weight, g/mol:	235.154544
ΔH_f, kcal/mol:	116.78
Dipole, Da:	8.63
IP(EA), eV:	-9.4(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations