Geometry & MOs

Info

ID:	313011
PubChem CID:	126610765
Reduced:	FNO6C24H30 (1)
Stoich.:	ABC6D24E30 (1)
Weight, g/mol:	273.100108
ΔH_f, kcal/mol:	-302.6
Dipole, Da:	6.14
IP(EA), eV:	-8.76(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethoxy)-4-methyl-1-(2-nitrophenyl)benzene

Drug info:

PubChemData

Smile

C[C@@H]1[C@H]([C@H]([C@@H](OC1(C)C)OC2=C(C(=C(C=C2)CCNC(=O)C)C3=CC(=CC=C3)F)O)O)O

DOS

IR

Vibrations