Geometry & MOs

Info

ID:	434399
PubChem CID:	135174846
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	578.408358
ΔH_f, kcal/mol:	-84.11
Dipole, Da:	1.56
IP(EA), eV:	-8.68(2.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[6-[1-(tert-butylamino)propan-2-yloxy]-1-benzofuran-2-yl]-2,3-dimethylbutan-2-yl]-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC(C)OCCN1CC[C@@H](C1)NC(C)(C)C

DOS

IR

Vibrations