Geometry & MOs

Info

ID:	138696
PubChem CID:	52411338
Reduced:	N5O5C18H21 (1)
Stoich.:	A5B5C18D21 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-68.51
Dipole, Da:	4.85
IP(EA), eV:	-9.36(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CNC(=O)NCC3=CC=CO3

DOS

IR

Vibrations