Geometry & MOs

Info

ID:	179528
PubChem CID:	76494193
Reduced:	NSO3C31H43 (1)
Stoich.:	ABC3D31E43 (1)
Weight, g/mol:	209.096951
ΔH_f, kcal/mol:	-95.19
Dipole, Da:	4.86
IP(EA), eV:	-8.63(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-phenylethylphosphanylamino)propanal

Drug info:

PubChemData

Smile

CC1=CN=C(S1)C2(CC2)C(C=CC(C)C3CCC4C3(CCCC4=CC=C5CC(CC(C5=C)O)O)C)O

DOS

IR

Vibrations