Geometry & MOs

Info

ID:	345675
PubChem CID:	127269975
Reduced:	ON4C19H24 (1)
Stoich.:	AB4C19D24 (1)
Weight, g/mol:	252.183778
ΔH_f, kcal/mol:	4.97
Dipole, Da:	7.26
IP(EA), eV:	-9.27(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C2N1C=C(C=C2)C(=O)N(C)C3C4CC5CC(C4)CC3C5

DOS

IR

Vibrations