Geometry & MOs

Info

ID:	44272
PubChem CID:	10502327
Reduced:	SN4O7C17H18 (1)
Stoich.:	AB4C7D17E18 (1)
Weight, g/mol:	422.091198
ΔH_f, kcal/mol:	-137.63
Dipole, Da:	2.83
IP(EA), eV:	-9.94(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-[[4-[2-[5-methyl-2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-oxazol-4-yl]ethoxy]phenyl]methylidene]hydroxylamine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1S(=O)(=O)NC(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)NO

DOS

IR

Vibrations