Geometry & MOs

Info

ID:	295701
PubChem CID:	117543000
Reduced:	O5C14H16 (1)
Stoich.:	A5B14C16 (1)
Weight, g/mol:	192.126263
ΔH_f, kcal/mol:	-177.07
Dipole, Da:	7.86
IP(EA), eV:	-9.02(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(pyridin-4-ylmethyl)pyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)C2(CC2C(=O)O)C(=O)O)OC

DOS

IR

Vibrations