Geometry & MOs

Info

ID:	433891
PubChem CID:	135174038
Reduced:	SN2C19H20 (1)
Stoich.:	AB2C19D20 (1)
Weight, g/mol:	353.094758
ΔH_f, kcal/mol:	101.4
Dipole, Da:	2.87
IP(EA), eV:	-7.63(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[chloro(phenoxy)phosphoryl]-1-[(2-methylphenyl)methoxy]propan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1S)N/C(=C\2/C(=C\C=C)/C=C(C=N2)C=C)/C

DOS

IR

Vibrations