Geometry & MOs

Info

ID:	195314
PubChem CID:	78672339
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	313.134779
ΔH_f, kcal/mol:	-59.99
Dipole, Da:	4.75
IP(EA), eV:	-8.6(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3,4-dimethylphenyl)sulfonylamino]-3-methylpentanoate

Drug info:

PubChemData

Smile

CC1CCCCN1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations