Geometry & MOs

Info

ID:	410471
PubChem CID:	135083269
Reduced:	NOPC33H38 (1)
Stoich.:	ABCD33E38 (1)
Weight, g/mol:	347.237802
ΔH_f, kcal/mol:	2.7
Dipole, Da:	4.48
IP(EA), eV:	-8.51(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-ditert-butylphosphanylphenyl)-N,N-diethylprop-2-enamide

Drug info:

PubChemData

Smile

C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3/C=C/C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations