Geometry & MOs

Info

ID:	345996
PubChem CID:	127270313
Reduced:	N2O3C20H22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	238.204513
ΔH_f, kcal/mol:	-78.09
Dipole, Da:	3.65
IP(EA), eV:	-9.14(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methylpiperidin-4-yl)cycloheptanecarboxamide

Drug info:

PubChemData

Smile

C1COC(CO1)CNC(=O)N2CC3=CC=CC=C3C4=CC=CC=C4C2

DOS

IR

Vibrations