Geometry & MOs

Info

ID:	261082
PubChem CID:	103216563
Reduced:	ClINSC14H15 (1)
Stoich.:	ABCDE14F15 (1)
Weight, g/mol:	237.108897
ΔH_f, kcal/mol:	49.31
Dipole, Da:	3.07
IP(EA), eV:	-9.07(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpyrazol-3-yl)-2-(2,2,2-trifluoroethoxy)ethanamine

Drug info:

PubChemData

Smile

CCNC(C1=CC(=C(C=C1)I)Cl)C2=C(SC=C2)C

DOS

IR

Vibrations