Geometry & MOs

Info

ID:	443514
PubChem CID:	135259230
Reduced:	ON7H13C15 (1)
Stoich.:	AB7C13D15 (1)
Weight, g/mol:	507.205259
ΔH_f, kcal/mol:	129.34
Dipole, Da:	3.19
IP(EA), eV:	-8.64(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[6-[4-(dimethylamino)piperidine-1-carbonyl]thieno[2,3-d]pyrimidin-4-yl]amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclobutane]-1,5-dione

Drug info:

PubChemData

Smile

CC1=C2C(=O)NC3(N2C(=C3)C(=C1)NC4=NC=NC5=C4C=NN5)C

DOS

IR

Vibrations