Geometry & MOs

Info

ID:	145689
PubChem CID:	53571722
Reduced:	ON3C18H25 (1)
Stoich.:	AB3C18D25 (1)
Weight, g/mol:	323.124547
ΔH_f, kcal/mol:	-11.11
Dipole, Da:	4.32
IP(EA), eV:	-8.6(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpyrazol-4-yl)-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C=CCN(C1CCCC1)C(=O)C2=CN=C(C=C2)N3CCCC3

DOS

IR

Vibrations