Geometry & MOs

Info

ID:	375391
PubChem CID:	131500180
Reduced:	NOSC12H19 (1)
Stoich.:	ABCD12E19 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-46.43
Dipole, Da:	1.61
IP(EA), eV:	-8.4(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methyl-2-[(2S)-piperidin-2-yl]phenyl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)[C@@H](C1=C(C=CC(=C1)O)SC)N

DOS

IR

Vibrations