Geometry & MOs

Info

ID:	27433
PubChem CID:	821316
Reduced:	OC7H11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	304.028252
ΔH_f, kcal/mol:	-104.21
Dipole, Da:	4.23
IP(EA), eV:	-10.01(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-methylphenyl)-5-(4-chlorophenyl)tetrazole

Drug info:

PubChemData

Smile

C[C@H]1CC[C@@H]2[C@@H]1[C@@H]3[C@@H](C3(C)C)[C@H](CC2=O)O

DOS

IR

Vibrations