Geometry & MOs

Info

ID:	201608
PubChem CID:	79562476
Reduced:	SN2O3C15H24 (1)
Stoich.:	AB2C3D15E24 (1)
Weight, g/mol:	306.140199
ΔH_f, kcal/mol:	-129.39
Dipole, Da:	4.38
IP(EA), eV:	-8.64(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(2-methylquinolin-4-yl)methyl]-2-methylsulfonylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C(C)NCC(C)(C)S(=O)(=O)C

DOS

IR

Vibrations