Geometry & MOs

Info

ID:	369551
PubChem CID:	127334573
Reduced:	O3N4C20H20 (1)
Stoich.:	A3B4C20D20 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-67.03
Dipole, Da:	6.3
IP(EA), eV:	-8.0(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-morpholin-4-yl-4-oxo-N-(2-propan-2-ylindazol-5-yl)butanamide

Drug info:

PubChemData

Smile

CC(C)N1C=C2C=C(C=CC2=N1)NC(=O)C3=CC4=C(CCCC4=O)NC3=O

DOS

IR

Vibrations