Geometry & MOs

Info

ID:	276118
PubChem CID:	103820716
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	298.03169
ΔH_f, kcal/mol:	-128.73
Dipole, Da:	4.36
IP(EA), eV:	-9.17(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromopyridin-3-yl)-[4-(hydroxymethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCC1CO)C(=O)C2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations