Geometry & MOs

Info

ID:	235226
PubChem CID:	92304247
Reduced:	FON2C23H25 (1)
Stoich.:	ABC2D23E25 (1)
Weight, g/mol:	192.126263
ΔH_f, kcal/mol:	-45.36
Dipole, Da:	4.79
IP(EA), eV:	-8.15(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(3S)-1-methylpyrrolidin-3-yl]-pyridin-3-ylmethanol

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@@H](CC(=O)N3CCCC3)C4=CC(=CC=C4)F

DOS

IR

Vibrations