Geometry & MOs

Info

ID:	233318
PubChem CID:	89649995
Reduced:	FN2O4C17H23 (1)
Stoich.:	AB2C4D17E23 (1)
Weight, g/mol:	220.088164
ΔH_f, kcal/mol:	-222.94
Dipole, Da:	6.12
IP(EA), eV:	-9.57(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-sulfanylacetyl)amino]pentylcarbamic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(C=CC(=C2)F)C(=O)O

DOS

IR

Vibrations