Geometry & MOs

Info

ID:	141224
PubChem CID:	52842394
Reduced:	NO4C18H27 (1)
Stoich.:	AB4C18D27 (1)
Weight, g/mol:	321.194008
ΔH_f, kcal/mol:	-167.63
Dipole, Da:	5.42
IP(EA), eV:	-8.99(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[methyl-[3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]propanoyl]amino]acetate

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H]1C2=CC=C(O2)CCC(=O)N(C)CC(=O)OC(C)(C)C

DOS

IR

Vibrations