Geometry & MOs

Info

ID:	278898
PubChem CID:	103839723
Reduced:	N3O4C14H21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	310.171499
ΔH_f, kcal/mol:	-91.43
Dipole, Da:	7.12
IP(EA), eV:	-9.22(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2-phenylethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NCC(C)(CN(C)C)O)[N+](=O)[O-]

DOS

IR

Vibrations