Geometry & MOs

Info

ID:	404228
PubChem CID:	135065503
Reduced:	NPO4C29H38 (1)
Stoich.:	ABC4D29E38 (1)
Weight, g/mol:	356.165365
ΔH_f, kcal/mol:	-198.74
Dipole, Da:	5.76
IP(EA), eV:	-8.51(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[phenyl-(propan-2-ylamino)-(2-prop-2-enylphenyl)-lambda5-phosphanylidene]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)C)P(=O)(C3=CC=CC=C3)O[C@@H]4C[C@H](CC[C@H]4C(C)C)C

DOS

IR

Vibrations