Geometry & MOs

Info

ID:	329136
PubChem CID:	126731362
Reduced:	N2O5C34H48 (1)
Stoich.:	A2B5C34D48 (1)
Weight, g/mol:	369.220498
ΔH_f, kcal/mol:	-168.95
Dipole, Da:	5.7
IP(EA), eV:	-7.57(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-5-cyclohexylidenepent-3-en-2-yl]-3,5-diphenyl-1,2,4-triazole

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C(=C1)OC)C(C2=C(C=C(C=C2OC)C)C)C3=C(C=C(C=C3OC)N(CC)CC)OC)OC

DOS

IR

Vibrations