Geometry & MOs

Info

ID:	248857
PubChem CID:	103085024
Reduced:	O2N5C14H21 (1)
Stoich.:	A2B5C14D21 (1)
Weight, g/mol:	295.119988
ΔH_f, kcal/mol:	4.12
Dipole, Da:	9.13
IP(EA), eV:	-9.25(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(3-chloro-4-methoxyphenyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations