Geometry & MOs

Info

ID:	282779
PubChem CID:	103938694
Reduced:	ON3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	263.199762
ΔH_f, kcal/mol:	-37.02
Dipole, Da:	1.74
IP(EA), eV:	-8.32(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridin-2-yl]propan-1-ol

Drug info:

PubChemData

Smile

CC[C@@H](C1=NC=C(C=C1)N2CCN(CC2)C(C)CC)O

DOS

IR

Vibrations