Geometry & MOs

Info

ID:	61683
PubChem CID:	26711772
Reduced:	SN2O3C19H30 (1)
Stoich.:	AB2C3D19E30 (1)
Weight, g/mol:	391.138819
ΔH_f, kcal/mol:	-149.29
Dipole, Da:	6.07
IP(EA), eV:	-9.17(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-2-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)methylsulfanyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCCC(=O)NC2CCCCCC2

DOS

IR

Vibrations