Geometry & MOs

Info

ID:	194283
PubChem CID:	78510653
Reduced:	N2O5C21H22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	288.074621
ΔH_f, kcal/mol:	-82.36
Dipole, Da:	4.63
IP(EA), eV:	-9.13(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-1,2-oxazol-3-yl)methyl 3-(2-nitrophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CN(C)C(=O)COC(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C

DOS

IR

Vibrations