Geometry & MOs

Info

ID:	78377
PubChem CID:	49689263
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	367.200825
ΔH_f, kcal/mol:	-21.34
Dipole, Da:	9.34
IP(EA), eV:	-8.57(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-N-[[1-(pyrazine-2-carbonyl)piperidin-4-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=O)NCC2CCN(CC2)C(=O)C3=NC=CN=C3

DOS

IR

Vibrations