Geometry & MOs

Info

ID:	131362
PubChem CID:	51195968
Reduced:	N2O2F3C21H23 (1)
Stoich.:	A2B2C3D21E23 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-234.3
Dipole, Da:	5.36
IP(EA), eV:	-9.42(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2-nitrophenyl)acetyl]amino]-N-propylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CC(=O)NC(C)C2=CC(=CC=C2)C(F)(F)F)NC(=O)C

DOS

IR

Vibrations