Geometry & MOs

Info

ID:	174582
PubChem CID:	75788162
Reduced:	NSO7C24H27 (1)
Stoich.:	ABC7D24E27 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-214.92
Dipole, Da:	7.11
IP(EA), eV:	-8.32(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-5-propan-2-yl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)N(CC3=CC(=C(C(=C3)OC)OC)OC)C4CCS(=O)(=O)C4

DOS

IR

Vibrations