Geometry & MOs

Info

ID:	263705
PubChem CID:	103391142
Reduced:	NOC7H14 (2)
Stoich.:	ABC7D14 (2)
Weight, g/mol:	229.11365
ΔH_f, kcal/mol:	-123.41
Dipole, Da:	2.71
IP(EA), eV:	-9.16(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-methoxy-2-(3-methylthiophen-2-yl)pentan-2-ol

Drug info:

PubChemData

Smile

CC(CNC(=O)OC(C)(C)C)NCCCC1CC1

DOS

IR

Vibrations