Geometry & MOs

Info

ID:	271758
PubChem CID:	103691093
Reduced:	N2O2S2C15H24 (1)
Stoich.:	A2B2C2D15E24 (1)
Weight, g/mol:	329.094934
ΔH_f, kcal/mol:	-97.25
Dipole, Da:	4.35
IP(EA), eV:	-8.74(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dichlorophenyl)-N-[(3-hydroxycyclohexyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CSCCC(=O)NCC2CCCC(C2)O

DOS

IR

Vibrations