Geometry & MOs

Info

ID:	160868
PubChem CID:	57390050
Reduced:	FON6H21C22 (1)
Stoich.:	ABC6D21E22 (1)
Weight, g/mol:	353.221561
ΔH_f, kcal/mol:	63.32
Dipole, Da:	4.53
IP(EA), eV:	-8.84(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(3-methylanilino)-N-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N2N=CC=N2)C(=O)N(C)CCN3C=C(C=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations