Geometry & MOs

Info

ID:	140490
PubChem CID:	52708392
Reduced:	O3N7C24H27 (1)
Stoich.:	A3B7C24D27 (1)
Weight, g/mol:	412.091535
ΔH_f, kcal/mol:	-14.49
Dipole, Da:	6.31
IP(EA), eV:	-9.41(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[(1R)-1-naphthalen-2-ylethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)NCC(=O)NNC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations