Geometry & MOs

Info

ID:	412120
PubChem CID:	135084994
Reduced:	NOPH21C27 (2)
Stoich.:	ABCD21E27 (2)
Weight, g/mol:	263.855903
ΔH_f, kcal/mol:	107.57
Dipole, Da:	5.77
IP(EA), eV:	-8.38(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C(=O)N[C@@H]4C(C5C6=CC=CC=C6C4C7=CC=CC=C57)NC(=O)C8=CC=CC=C8P(C9=CC=CC=C9)C1=CC=CC=C1

DOS

IR

Vibrations