Geometry & MOs

Info

ID:	170359
PubChem CID:	75221052
Reduced:	O3C20H30 (1)
Stoich.:	A3B20C30 (1)
Weight, g/mol:	711.243678
ΔH_f, kcal/mol:	-155.3
Dipole, Da:	7.03
IP(EA), eV:	-10.04(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-hydroxy-3-(4-phenylmethoxyphenyl)propan-2-yl]-4-methyl-N-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1H-quinoxalin-2-yl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC12CCCC(C1CCC34C2CC5C(C3)C5(C4)CO)(C)C(=O)O

DOS

IR

Vibrations