Geometry & MOs

Info

ID:	443427
PubChem CID:	135258977
Reduced:	N3O7C17H27 (1)
Stoich.:	A3B7C17D27 (1)
Weight, g/mol:	375.169525
ΔH_f, kcal/mol:	-303.62
Dipole, Da:	4.35
IP(EA), eV:	-9.4(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-7-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)spiro[2,4-dihydrocyclohepta[c]pyridine-3,1'-cyclopentane]-1,6-dione

Drug info:

PubChemData

Smile

CCCCCCCC(=O)OCC1C(C(C(O1)N2C=NC(=C2O)C(=O)N)O)O

DOS

IR

Vibrations