Geometry & MOs

Info

ID:	414479
PubChem CID:	135087437
Reduced:	N6O7C36H46 (1)
Stoich.:	A6B7C36D46 (1)
Weight, g/mol:	366.136176
ΔH_f, kcal/mol:	-212.69
Dipole, Da:	4.97
IP(EA), eV:	-8.8(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-(2H-indazol-3-yl)acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](CN(CC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)OC)CC(C)C)C(=O)C3=C(ON=C3)C4=CC=CC=C4)C(C)C

DOS

IR

Vibrations