Geometry & MOs

Info

ID:	287777
PubChem CID:	104294325
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-10.18
Dipole, Da:	2.41
IP(EA), eV:	-9.04(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[[2-(3-methyl-5-nitrophenyl)-1,3-oxazol-4-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCNCCCC1=NC=C(O1)C2=CC(=CC(=C2)C)[N+](=O)[O-]

DOS

IR

Vibrations