Geometry & MOs

Info

ID:	348698
PubChem CID:	127273809
Reduced:	SO2N4C13H22 (1)
Stoich.:	AB2C4D13E22 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-59.84
Dipole, Da:	10.56
IP(EA), eV:	-8.53(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(pyridin-3-ylamino)propyl]cycloheptanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)N2CCN3CCCCC3C2

DOS

IR

Vibrations