Geometry & MOs

Info

ID:	364007
PubChem CID:	127313678
Reduced:	SO3N4C18H20 (1)
Stoich.:	AB3C4D18E20 (1)
Weight, g/mol:	330.148061
ΔH_f, kcal/mol:	-43.98
Dipole, Da:	2.16
IP(EA), eV:	-9.81(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCC4=CN=CN=C4C3

DOS

IR

Vibrations