Geometry & MOs

Info

ID:	248938
PubChem CID:	103085650
Reduced:	ON5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	289.19026
ΔH_f, kcal/mol:	44.9
Dipole, Da:	6.73
IP(EA), eV:	-8.91(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-[(3-methoxyphenyl)methyl]tetrazol-5-yl]ethyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1CCCOC2=CC=CC=C2

DOS

IR

Vibrations