Geometry & MOs

Info

ID:	447282
PubChem CID:	135281741
Reduced:	NCl2O4C29H31 (1)
Stoich.:	AB2C4D29E31 (1)
Weight, g/mol:	371.203134
ΔH_f, kcal/mol:	-155.82
Dipole, Da:	3.2
IP(EA), eV:	-9.42(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-N-[(3S)-3-(3-aminophenyl)-3-cyclopropyl-3-pyridin-4-ylpropyl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC(C)(CCOC1(C2=C(C=C(C=C2)C(C)(C)O)C(=O)N1CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)O

DOS

IR

Vibrations