Geometry & MOs

Info

ID:	438427
PubChem CID:	135228165
Reduced:	NO5C14H27 (1)
Stoich.:	AB5C14D27 (1)
Weight, g/mol:	230.170437
ΔH_f, kcal/mol:	-268.21
Dipole, Da:	7.02
IP(EA), eV:	-10.04(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-butylsulfanylcyclopropyl)-4-methylpentan-2-ol

Drug info:

PubChemData

Smile

CCOC(C)(C)CCOC(C)(C)CC(=O)NCC(=O)O

DOS

IR

Vibrations