Geometry & MOs

Info

ID:	361134
PubChem CID:	127302078
Reduced:	SO2N3C21H27 (1)
Stoich.:	AB2C3D21E27 (1)
Weight, g/mol:	397.182398
ΔH_f, kcal/mol:	-70.17
Dipole, Da:	7.15
IP(EA), eV:	-9.12(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-[2-(4-cyclohexyl-1,3-thiazol-2-yl)ethyl]-2,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CCC2)C(=O)NCCC3=NC(=CS3)C4CCCCC4

DOS

IR

Vibrations