Geometry & MOs

Info

ID:	164164
PubChem CID:	74382149
Reduced:	FN4O5H19C22 (1)
Stoich.:	AB4C5D19E22 (1)
Weight, g/mol:	426.113745
ΔH_f, kcal/mol:	-177.92
Dipole, Da:	7.96
IP(EA), eV:	-9.37(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-amino-3-[2-(trifluoromethyl)phenyl]propan-2-yl]-4-(4-fluoro-2-methylpyrazol-3-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C4=NCC(=O)C(=O)N4)F

DOS

IR

Vibrations