Geometry & MOs

Info

ID:	220547
PubChem CID:	85197736
Reduced:	NPO5C15H22 (1)
Stoich.:	ABC5D15E22 (1)
Weight, g/mol:	327.148396
ΔH_f, kcal/mol:	-255.44
Dipole, Da:	7.23
IP(EA), eV:	-8.54(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-6-(2-naphthalen-1-ylethenyl)pyrido[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCOC=C(C(=O)NC1=CC=CC=C1)P(=O)(OCC)OCC

DOS

IR

Vibrations