Geometry & MOs

Info

ID:	175242
PubChem CID:	75872112
Reduced:	FNOSC17H18 (1)
Stoich.:	ABCDE17F18 (1)
Weight, g/mol:	313.147807
ΔH_f, kcal/mol:	-28.85
Dipole, Da:	5.46
IP(EA), eV:	-9.28(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N(C2CC2)C(C)C3=CC=CC=C3F

DOS

IR

Vibrations