Geometry & MOs

Info

ID:	228827
PubChem CID:	87565890
Reduced:	ON2C8H20 (1)
Stoich.:	AB2C8D20 (1)
Weight, g/mol:	479.139208
ΔH_f, kcal/mol:	-49.73
Dipole, Da:	2.37
IP(EA), eV:	-8.53(2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,4-diamino-7-[2-ethoxy-6-(trifluoromethyl)phenyl]-3-methyl-2,4-dihydropyrido[2,3-d]pyrimidin-1-yl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

CCOC(CN(C)C)N(C)C

DOS

IR

Vibrations