Geometry & MOs

Info

ID:	351170
PubChem CID:	127279728
Reduced:	SN3O3C19H27 (1)
Stoich.:	AB3C3D19E27 (1)
Weight, g/mol:	379.18173
ΔH_f, kcal/mol:	-114.35
Dipole, Da:	4.32
IP(EA), eV:	-8.78(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylsulfonyl-N-(3,4-dihydro-2H-chromen-6-yl)-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1=CN2C=C(C=CC2=N1)NC(=O)C(C(C)C)S(=O)(=O)C3CCCCC3

DOS

IR

Vibrations