Geometry & MOs

Info

ID:	278055
PubChem CID:	103833033
Reduced:	OSN2C11H22 (1)
Stoich.:	ABC2D11E22 (1)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-78.78
Dipole, Da:	3.1
IP(EA), eV:	-8.61(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1-hydroxyethyl)piperidin-1-yl]-(4-methoxypyrrolidin-2-yl)methanone

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NC1CCSCC1)N

DOS

IR

Vibrations