Geometry & MOs

Info

ID:	31687
PubChem CID:	856020
Reduced:	N2O4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	176.069811
ΔH_f, kcal/mol:	-76.53
Dipole, Da:	1.33
IP(EA), eV:	-8.63(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxyphenyl)tetrazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CN(CC2=CC=CO2)C(=O)C3=CC=CO3

DOS

IR

Vibrations