Geometry & MOs

Info

ID:	171882
PubChem CID:	75436659
Reduced:	N3O4H15C18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	276.119796
ΔH_f, kcal/mol:	-48.5
Dipole, Da:	4.05
IP(EA), eV:	-9.04(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropyl(ethyl)amino]-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]acetamide

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2NC1=O)CNC(=O)C3=C(ON=C3)C4=CC=CO4

DOS

IR

Vibrations