Geometry & MOs

Info

ID:	419650
PubChem CID:	135108665
Reduced:	N5O5C33H43 (1)
Stoich.:	A5B5C33D43 (1)
Weight, g/mol:	397.167142
ΔH_f, kcal/mol:	-190.21
Dipole, Da:	9.13
IP(EA), eV:	-9.17(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-(2-methylpropanoylamino)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](C(=O)N(CC(=O)N[C@H](C(=O)NCCCN1C(=O)C2CC3=CC=CC=C3C2)CC4=CC=CC=C4)C)C(C)C

DOS

IR

Vibrations