Geometry & MOs

Info

ID:	364035
PubChem CID:	127313706
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	270.111676
ΔH_f, kcal/mol:	-69.1
Dipole, Da:	4.95
IP(EA), eV:	-9.73(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-cyclopropyl-1,2-oxazol-3-yl)-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methanone

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)NCC(=O)N2CCC3=CN=CN=C3C2

DOS

IR

Vibrations