Geometry & MOs

Info

ID:	57695
PubChem CID:	22433429
Reduced:	ClOSN2C25H27 (1)
Stoich.:	ABCD2E25F27 (1)
Weight, g/mol:	464.213364
ΔH_f, kcal/mol:	6.64
Dipole, Da:	3.93
IP(EA), eV:	-8.63(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]-3,4-dimethoxy-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCN(C1=NC(=CS1)C2=CC=C(C=C2)C3CCCCC3)C(=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations