Geometry & MOs

Info

ID:	369111
PubChem CID:	127331286
Reduced:	O2N5C19H23 (1)
Stoich.:	A2B5C19D23 (1)
Weight, g/mol:	321.147727
ΔH_f, kcal/mol:	11.2
Dipole, Da:	11.5
IP(EA), eV:	-8.79(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=NC=NC(=C12)NC(=O)C3=NN(C(=C3)C4CC4)C(C)(C)C)C

DOS

IR

Vibrations