Geometry & MOs

Info

ID:	129558
PubChem CID:	51073086
Reduced:	SN2O2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	235.137242
ΔH_f, kcal/mol:	21.11
Dipole, Da:	4.4
IP(EA), eV:	-9.2(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(3-fluorophenyl)methyl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N(CC=C)CC2=CC=CS2

DOS

IR

Vibrations