Geometry & MOs

Info

ID:	232666
PubChem CID:	87576671
Reduced:	BrClSiO3N4C22H30 (1)
Stoich.:	ABCD3E4F22G30 (1)
Weight, g/mol:	333.099252
ΔH_f, kcal/mol:	-128.86
Dipole, Da:	3.46
IP(EA), eV:	-8.8(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-amino-4-chloro-7-(2,3-dihydrofuro[3,2-b]pyridin-6-ylmethyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-5-yl]methanol

Drug info:

PubChemData

Smile

CC1=C2C(=CC(=C1CN3CC(C4=C3N=C(N=C4Cl)N)CO[Si](C)(C)C(C)(C)C)Br)OCO2

DOS

IR

Vibrations