Geometry & MOs

Info

ID:	42946
PubChem CID:	10317324
Reduced:	O2F3N3H16C19 (1)
Stoich.:	A2B3C3D16E19 (1)
Weight, g/mol:	375.158292
ΔH_f, kcal/mol:	-181.61
Dipole, Da:	1.98
IP(EA), eV:	-8.68(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(morpholin-4-ylmethyl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]benzoic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=CC=C2NC(=O)NCC3=CC=C(C=C3)OC(F)(F)F)C=N1

DOS

IR

Vibrations