Geometry & MOs

Info

ID:	177223
PubChem CID:	76147989
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	-32.04
Dipole, Da:	2.49
IP(EA), eV:	-8.97(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)C(=O)NCC2=NC(=NC=C2)N3CCOCC3

DOS

IR

Vibrations