Geometry & MOs

Info

ID:	70880
PubChem CID:	48413992
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	368.130697
ΔH_f, kcal/mol:	-39.09
Dipole, Da:	4.73
IP(EA), eV:	-9.42(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(5-methyl-1H-pyrazol-4-yl)methylamino]-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CO3

DOS

IR

Vibrations