Geometry & MOs

Info

ID:	273131
PubChem CID:	103770544
Reduced:	ClNSO2C16H24 (1)
Stoich.:	ABCD2E16F24 (1)
Weight, g/mol:	297.174022
ΔH_f, kcal/mol:	-110.86
Dipole, Da:	2.24
IP(EA), eV:	-9.24(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-2-hydroxypentyl)-3-(2-fluorophenoxy)propanamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)CCSC1=CC=C(C=C1)Cl)O

DOS

IR

Vibrations