Geometry & MOs

Info

ID:	75106
PubChem CID:	48423000
Reduced:	NO4C18H27 (1)
Stoich.:	AB4C18D27 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-141.04
Dipole, Da:	1.52
IP(EA), eV:	-8.35(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-(2-oxoazepan-3-yl)propanamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)CNC(=O)C(C)OCC2CC2)OC

DOS

IR

Vibrations