Geometry & MOs

Info

ID:	358846
PubChem CID:	127296717
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	375.182792
ΔH_f, kcal/mol:	-136.37
Dipole, Da:	6.5
IP(EA), eV:	-9.37(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,1-dioxothiolan-3-yl)carbamoyl]-2-(4-propoxyazepan-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCS(=O)(=O)C1)N2CCC(=C)CC2

DOS

IR

Vibrations