Geometry & MOs

Info

ID:	295224
PubChem CID:	117522132
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	233.12766
ΔH_f, kcal/mol:	-84.86
Dipole, Da:	10.1
IP(EA), eV:	-9.5(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(3-methoxyphenyl)tetrazol-2-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CN1C=C(C(=O)C(=C1)C(=O)O)CC2=CC=CC=C2

DOS

IR

Vibrations