Geometry & MOs

Info

ID:	69363
PubChem CID:	46530845
Reduced:	N3O4H23C27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	305.153955
ΔH_f, kcal/mol:	-0.43
Dipole, Da:	4.62
IP(EA), eV:	-8.64(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2=CC=C(C=C2)C(=O)N(C/C=C/C3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations