Geometry & MOs

Info

ID:	128330
PubChem CID:	51039957
Reduced:	N2O4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-127.95
Dipole, Da:	7.31
IP(EA), eV:	-8.49(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5,8-dimethoxy-7-methylnaphthalen-2-yl)methyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C2C=CC(=CC2=C1OC)CN3C=C(C(=O)NC3=O)C)OC

DOS

IR

Vibrations