Geometry & MOs

Info

ID:	48091
PubChem CID:	10537095
Reduced:	SO6C7H12 (1)
Stoich.:	AB6C7D12 (1)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	-251.21
Dipole, Da:	3.23
IP(EA), eV:	-9.51(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-methyl-1-phenyl-2-piperidin-1-ylethanamine

Drug info:

PubChemData

Smile

C(C([C@H]1[C@H](OC(=S)O1)C(CO)O)O)O

DOS

IR

Vibrations