Geometry & MOs

Info

ID:	85795
PubChem CID:	49879245
Reduced:	ON6C23H30 (1)
Stoich.:	AB6C23D30 (1)
Weight, g/mol:	475.177503
ΔH_f, kcal/mol:	23.91
Dipole, Da:	2.84
IP(EA), eV:	-8.95(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-chlorophenyl)methylamino]-3-methyl-N-(oxolan-2-ylmethyl)-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)N1CCN(CC1)CCN2C3=C(C=CC=N3)N=C2C4=CC=C(C=C4)C

DOS

IR

Vibrations