Geometry & MOs

Info

ID:	401815
PubChem CID:	135052751
Reduced:	N4O4C13H18 (1)
Stoich.:	A4B4C13D18 (1)
Weight, g/mol:	294.136828
ΔH_f, kcal/mol:	33.15
Dipole, Da:	7.75
IP(EA), eV:	-9.98(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(dimethylamino)-3-phenyl-4,5-dihydro-1,2-oxazol-4-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CCC1(N(N1C(C)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C

DOS

IR

Vibrations