Geometry & MOs

Info

ID:	281961
PubChem CID:	103914605
Reduced:	ON2C14H30 (1)
Stoich.:	AB2C14D30 (1)
Weight, g/mol:	251.155515
ΔH_f, kcal/mol:	-87.88
Dipole, Da:	2.59
IP(EA), eV:	-8.6(2.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-ethylsulfonylpropan-2-ylamino)-2-methylpentan-1-ol

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)NCCCC(C)CO

DOS

IR

Vibrations