Geometry & MOs

Info

ID:	445663
PubChem CID:	135268823
Reduced:	ClN5C23H34 (1)
Stoich.:	AB5C23D34 (1)
Weight, g/mol:	390.19032
ΔH_f, kcal/mol:	24.03
Dipole, Da:	0.91
IP(EA), eV:	-8.0(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxypropyl)-6-methoxy-5-[(3-methoxy-2-methyl-2,3-dihydropyridin-6-yl)methyl]-1-methylpyrrolo[3,2-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CNC(C1)CCC2NC(=C(N2CC3=CC=C(C=C3)Cl)C(=C)NC(C)(C)C)N

DOS

IR

Vibrations