Geometry & MOs

Info

ID:	443465
PubChem CID:	135259126
Reduced:	SN3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	465.158309
ΔH_f, kcal/mol:	70.58
Dipole, Da:	1.2
IP(EA), eV:	-8.7(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C/C(=C/1\C(=C)NC2(N1NC)CSC2)/C=C

DOS

IR

Vibrations