Geometry & MOs

Info

ID:	270696
PubChem CID:	103637719
Reduced:	SN3C11H23 (1)
Stoich.:	AB3C11D23 (1)
Weight, g/mol:	252.102941
ΔH_f, kcal/mol:	2.88
Dipole, Da:	5.87
IP(EA), eV:	-8.34(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloropyridin-3-yl)cycloheptanecarboxamide

Drug info:

PubChemData

Smile

CCN(CCNC(=S)NC(C)C)C1CC1

DOS

IR

Vibrations