Geometry & MOs

Info

ID:	287776
PubChem CID:	104294322
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-12.22
Dipole, Da:	4.81
IP(EA), eV:	-9.14(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)[N+](=O)[O-])C2=CN=C(O2)CCNC(C)C

DOS

IR

Vibrations