Geometry & MOs

Info

ID:	413505
PubChem CID:	135086454
Reduced:	SiO5C29H36 (1)
Stoich.:	AB5C29D36 (1)
Weight, g/mol:	270.111676
ΔH_f, kcal/mol:	-174.0
Dipole, Da:	3.41
IP(EA), eV:	-8.54(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-2-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)[Si](C)(C(C)C)OCC1=CC2=C(C(=C1)OC)OC(=C2C(=O)OCCCC#C)C3=CC=CC=C3

DOS

IR

Vibrations