Geometry & MOs

Info

ID:	398003
PubChem CID:	135031317
Reduced:	N4O5H24C30 (1)
Stoich.:	A4B5C24D30 (1)
Weight, g/mol:	726.246497
ΔH_f, kcal/mol:	-61.32
Dipole, Da:	1.31
IP(EA), eV:	-9.89(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-hydroxy-5-methoxycarbonyl-2-phenylmethoxyphenoxy)-3,4,5-tris(phenylmethoxy)benzoate

Drug info:

PubChemData

Smile

[C-]#[N+]C[C@@H]1[C@H](N(C(=O)N1C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)CCCN4C(=O)C5=CC=CC=C5C4=O

DOS

IR

Vibrations