Geometry & MOs

Info

ID:	286203
PubChem CID:	104161043
Reduced:	SN2O2C9H18 (1)
Stoich.:	AB2C2D9E18 (1)
Weight, g/mol:	218.108899
ΔH_f, kcal/mol:	-97.71
Dipole, Da:	4.93
IP(EA), eV:	-8.83(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-3-sulfanylidenepropyl)-4-methoxypentanamide

Drug info:

PubChemData

Smile

CC(CCC(=O)NC(C)C(=S)N)OC

DOS

IR

Vibrations