Geometry & MOs

Info

ID:	415659
PubChem CID:	135088658
Reduced:	OSN4C24H26 (1)
Stoich.:	ABC4D24E26 (1)
Weight, g/mol:	284.098334
ΔH_f, kcal/mol:	52.86
Dipole, Da:	2.79
IP(EA), eV:	-9.18(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-phenyl-N-[2-(1,3-thiazol-4-yl)ethyl]cycloprop-2-ene-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)[C@]1(C[C@H]2CC[C@@H]1N2CC3=CC=C(C=C3)C4=CC=CC=N4)CC5=CSC=N5

DOS

IR

Vibrations