Geometry & MOs

Info

ID:	172426
PubChem CID:	75508675
Reduced:	ClN2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	324.150764
ΔH_f, kcal/mol:	-133.6
Dipole, Da:	3.72
IP(EA), eV:	-8.51(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-phenacylazepane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](CO)NC(=O)NC1=CC(=CC2=C1OCC2)Cl

DOS

IR

Vibrations