Geometry & MOs

Info

ID:	241034
PubChem CID:	93621291
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	340.158706
ΔH_f, kcal/mol:	12.87
Dipole, Da:	4.78
IP(EA), eV:	-8.81(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropanecarbonyl(methyl)amino]-N-[(1S)-1-(2-fluorophenyl)ethyl]benzamide

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N(NC(=N1)C(=O)N[C@H](C)C2=CC=CC=N2)C3=CC=CC=C3

DOS

IR

Vibrations