Geometry & MOs

Info

ID:	61156
PubChem CID:	26706274
Reduced:	SN3O5C23H29 (1)
Stoich.:	AB3C5D23E29 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	-184.14
Dipole, Da:	10.13
IP(EA), eV:	-9.17(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-2-[[2-(3-methoxyphenyl)acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

DOS

IR

Vibrations