Geometry & MOs

Info

ID:	297825
PubChem CID:	117633155
Reduced:	N2O9C29H58 (1)
Stoich.:	A2B9C29D58 (1)
Weight, g/mol:	355.153206
ΔH_f, kcal/mol:	-467.5
Dipole, Da:	7.6
IP(EA), eV:	-9.38(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)methylimino]-2-nitroprop-1-en-1-amine

Drug info:

PubChemData

Smile

CCCCOCC1[C@@H]([C@@H](C([C@H](O1)OC[C@@H]([C@@H]([C@@H](CC)O)O)NC(=O)N)OCCCC)OCCCC)OCCCC

DOS

IR

Vibrations