Geometry & MOs

Info

ID:	145907
PubChem CID:	53610301
Reduced:	N3C8H10 (2)
Stoich.:	A3B8C10 (2)
Weight, g/mol:	317.108565
ΔH_f, kcal/mol:	110.43
Dipole, Da:	4.13
IP(EA), eV:	-9.01(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(2-methylphenyl)-phenylmethyl]sulfonylacetamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CCNCC2=CN(N=C2C3=CN=CC=C3)C

DOS

IR

Vibrations