Geometry & MOs

Info

ID:	249002
PubChem CID:	103086161
Reduced:	O2N5C12H17 (1)
Stoich.:	A2B5C12D17 (1)
Weight, g/mol:	235.179696
ΔH_f, kcal/mol:	9.99
Dipole, Da:	8.34
IP(EA), eV:	-9.29(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-bicyclo[2.2.1]heptanylmethyl)tetrazol-5-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1CC2=C(C=C(C=C2)OC)OC)N

DOS

IR

Vibrations