Geometry & MOs

Info

ID:	75574
PubChem CID:	48423678
Reduced:	N2O4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	304.158706
ΔH_f, kcal/mol:	-143.61
Dipole, Da:	0.87
IP(EA), eV:	-9.17(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyano-2-fluorophenyl)methyl]-2-(cyclopropylmethoxy)-N-ethylpropanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OCCNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations