Geometry & MOs

Info

ID:	150832
PubChem CID:	53790528
Reduced:	O5C24H40 (1)
Stoich.:	A5B24C40 (1)
Weight, g/mol:	271.103085
ΔH_f, kcal/mol:	-272.07
Dipole, Da:	2.21
IP(EA), eV:	-9.55(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-cyclopropyl-1,2-thiazol-4-yl)-(2,3,4-trimethylphenyl)methanone

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCC(=O)C1C(=O)OC(OC1=O)(C)C

DOS

IR

Vibrations