Geometry & MOs

Info

ID:	70619
PubChem CID:	48413603
Reduced:	BrON4C19H27 (1)
Stoich.:	ABC4D19E27 (1)
Weight, g/mol:	389.279075
ΔH_f, kcal/mol:	5.58
Dipole, Da:	4.27
IP(EA), eV:	-8.69(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylamino)pentan-2-yl]-3-(1,3,4-trimethyl-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)propanamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=CC=C(C=C1)N2C=C(C=N2)Br

DOS

IR

Vibrations