Geometry & MOs

Info

ID:	351106
PubChem CID:	127279664
Reduced:	N2O2S2H14C15 (1)
Stoich.:	A2B2C2D14E15 (1)
Weight, g/mol:	374.166414
ΔH_f, kcal/mol:	-14.39
Dipole, Da:	6.76
IP(EA), eV:	-9.02(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylsulfonyl-3-methyl-N-quinolin-5-ylbutanamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(S2)CCOC3)C

DOS

IR

Vibrations