Geometry & MOs

Info

ID:	273155
PubChem CID:	103770591
Reduced:	N2O2S2C15H26 (1)
Stoich.:	A2B2C2D15E26 (1)
Weight, g/mol:	257.235479
ΔH_f, kcal/mol:	-99.57
Dipole, Da:	2.09
IP(EA), eV:	-8.86(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-(3-ethyl-2-hydroxypentyl)hexanamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)CCSCC1=CSC(=N1)C)O

DOS

IR

Vibrations