Geometry & MOs

Info

ID:	423179
PubChem CID:	135119055
Reduced:	O3N6C20H24 (1)
Stoich.:	A3B6C20D24 (1)
Weight, g/mol:	387.162806
ΔH_f, kcal/mol:	2.63
Dipole, Da:	3.17
IP(EA), eV:	-9.41(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-[(4-fluorophenyl)methyl-methylamino]acetamide

Drug info:

PubChemData

Smile

CCCN1C=NN=C1CNC(=O)C2=C(ON=C2N3CCOCC3)C4=CC=CC=C4

DOS

IR

Vibrations