Geometry & MOs

Info

ID:	379751
PubChem CID:	134464264
Reduced:	N2O2C19H30 (1)
Stoich.:	A2B2C19D30 (1)
Weight, g/mol:	435.116126
ΔH_f, kcal/mol:	-102.17
Dipole, Da:	5.01
IP(EA), eV:	-9.13(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-chloro-4-methylphenyl)methyl]-2-[4-(difluoromethoxy)-2-methylanilino]-5-methoxypyrimidin-4-one

Drug info:

PubChemData

Smile

CCCC(C)CC(C)(C)CN(C=O)C1=CC=C(C=C1)C(=O)NC

DOS

IR

Vibrations