Geometry & MOs

Info

ID:	197576
PubChem CID:	78978827
Reduced:	NSCl2O4C13H15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-133.11
Dipole, Da:	6.32
IP(EA), eV:	-9.83(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cycloheptylamino)ethyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

CCOC(=O)CN(CC=C)S(=O)(=O)C1=C(C(=CC=C1)Cl)Cl

DOS

IR

Vibrations