Geometry & MOs

Info

ID:	448716
PubChem CID:	135292936
Reduced:	OF3N4C23H29 (1)
Stoich.:	AB3C4D23E29 (1)
Weight, g/mol:	267.158292
ΔH_f, kcal/mol:	-149.71
Dipole, Da:	6.71
IP(EA), eV:	-8.51(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methane;1-methoxy-4-[(4-nitrophenyl)methyl]piperazine

Drug info:

PubChemData

Smile

C/C=C\C(=C/C=C/NC1=NCC(=C(N1)CCC2=CCCC=C2CC(=O)N)C(F)(F)F)\C

DOS

IR

Vibrations