Geometry & MOs

Info

ID:	285976
PubChem CID:	104143087
Reduced:	ClNOC14H22 (1)
Stoich.:	ABCD14E22 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-69.85
Dipole, Da:	2.24
IP(EA), eV:	-9.16(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(hydroxymethyl)piperidin-1-yl]-[2-(methylamino)-6-propylpyridin-4-yl]methanone

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)CCl)OCCC(C)(C)C

DOS

IR

Vibrations