Geometry & MOs

Info

ID:	325713
PubChem CID:	126684608
Reduced:	NSO6C26H35 (1)
Stoich.:	ABC6D26E35 (1)
Weight, g/mol:	252.163791
ΔH_f, kcal/mol:	-262.92
Dipole, Da:	4.68
IP(EA), eV:	-8.9(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-fluoro-5-propan-2-ylphenyl)methylamino]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CC(C)CCC1=CC=C(S1)CC(C)C(=O)C2=C(C=C(OC2=O)C(C)CC/C=C/NC(=O)OC)O

DOS

IR

Vibrations