Geometry & MOs

Info

ID:	287775
PubChem CID:	104294268
Reduced:	FNOC16H16 (1)
Stoich.:	ABCD16E16 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-58.59
Dipole, Da:	4.46
IP(EA), eV:	-8.67(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[5-(3-methyl-5-nitrophenyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations