Geometry & MOs

Info

ID:	248935
PubChem CID:	103085635
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	265.226646
ΔH_f, kcal/mol:	43.06
Dipole, Da:	4.96
IP(EA), eV:	-9.35(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1C2CCOC3=CC=CC=C23

DOS

IR

Vibrations