Geometry & MOs

Info

ID:	368481
PubChem CID:	127329099
Reduced:	N2O4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-163.04
Dipole, Da:	5.43
IP(EA), eV:	-9.08(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxan-4-yl)-N-(2-oxoazepan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N2CCCC2)NC(=O)COC3CCOCC3

DOS

IR

Vibrations