Geometry & MOs

Info

ID:	409920
PubChem CID:	135082707
Reduced:	N4O16C49H58 (1)
Stoich.:	A4B16C49D58 (1)
Weight, g/mol:	124.89336
ΔH_f, kcal/mol:	-442.18
Dipole, Da:	9.67
IP(EA), eV:	-7.2(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

selenazaphosphirene

Drug info:

PubChemData

Smile

C[C@@]1([C@@H](C2=NC1=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=C2)N5)CC(=O)OC)CCC(=O)OC)CC(=O)OC)CCC(=O)OC)CCC(=O)OC)CC(=O)OC)CCC(=O)OC)CC(=O)OC

DOS

IR

Vibrations