Geometry & MOs

Info

ID:	18052
PubChem CID:	535364
Reduced:	SN3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	325.161269
ΔH_f, kcal/mol:	70.58
Dipole, Da:	3.95
IP(EA), eV:	-8.35(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-N-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)amino]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(=NNC3=NC(=CS3)C4=CC=CC=C4)C2)C)C

DOS

IR

Vibrations