Geometry & MOs

Info

ID:	263523
PubChem CID:	103375468
Reduced:	O2N5C12H13 (1)
Stoich.:	A2B5C12D13 (1)
Weight, g/mol:	285.15896
ΔH_f, kcal/mol:	2.93
Dipole, Da:	5.9
IP(EA), eV:	-9.42(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxypyridazin-3-yl)-4-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

Drug info:

PubChemData

Smile

COC1=NN=C(C=C1)C2=NC(=O)C3=C(N2)CNCC3

DOS

IR

Vibrations