Geometry & MOs

Info

ID:	343215
PubChem CID:	127266388
Reduced:	ClOSN4C10H17 (1)
Stoich.:	ABCD4E10F17 (1)
Weight, g/mol:	362.130028
ΔH_f, kcal/mol:	-39.35
Dipole, Da:	6.12
IP(EA), eV:	-9.74(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(methanesulfonamido)phenyl]methyl-(2-phenylethyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC1=C(SN=N1)C(=O)N2CCC(CC2)CN.Cl

DOS

IR

Vibrations