Geometry & MOs

Info

ID:	419613
PubChem CID:	135108547
Reduced:	OSN6C18H24 (1)
Stoich.:	ABC6D18E24 (1)
Weight, g/mol:	369.116348
ΔH_f, kcal/mol:	26.97
Dipole, Da:	3.92
IP(EA), eV:	-8.6(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-(oxan-4-yl)-2,4-bis(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CNC1=NC(=CS1)C(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C

DOS

IR

Vibrations