Geometry & MOs

Info

ID:	187125
PubChem CID:	77532773
Reduced:	N4O5C19H24 (1)
Stoich.:	A4B5C19D24 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-172.43
Dipole, Da:	8.64
IP(EA), eV:	-8.81(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-cyclohexa-1,5-dien-1-yl-4,5-dihydro-1,2-oxazol-5-yl)acetate

Drug info:

PubChemData

Smile

C1CCOC(C1)OC(C(CC2=CC=CC=C2)NC(=O)O)C(=O)NC3=NC=CN3

DOS

IR

Vibrations