Geometry & MOs

Info

ID:	269917
PubChem CID:	103619692
Reduced:	NSO2C15H25 (1)
Stoich.:	ABC2D15E25 (1)
Weight, g/mol:	311.1919
ΔH_f, kcal/mol:	-92.41
Dipole, Da:	2.3
IP(EA), eV:	-9.1(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-ethylthiophen-2-yl)methylamino]-3-(4-methylcyclohexyl)oxypropan-2-ol

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNCC(COC2CCCC2)O

DOS

IR

Vibrations