Geometry & MOs

Info

ID:	243626
PubChem CID:	99233479
Reduced:	N3O5C26H39 (1)
Stoich.:	A3B5C26D39 (1)
Weight, g/mol:	372.204907
ΔH_f, kcal/mol:	-244.38
Dipole, Da:	6.43
IP(EA), eV:	-8.82(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3R)-1-(5-methyl-1-benzofuran-2-carbonyl)piperidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC[C@@H]1CCCN(C1)C(=O)[C@@H]2CCCN(C2)C(=O)CCOC3=CC=CC=C3

DOS

IR

Vibrations