Geometry & MOs

Info

ID:	31682
PubChem CID:	856014
Reduced:	NOH9C11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	226.085461
ΔH_f, kcal/mol:	16.69
Dipole, Da:	3.24
IP(EA), eV:	-9.06(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(furan-2-yl)-1-(4-methylphenyl)tetrazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CO4

DOS

IR

Vibrations