Geometry & MOs

Info

ID:	174400
PubChem CID:	75761131
Reduced:	N2O3C31H44 (1)
Stoich.:	A2B3C31D44 (1)
Weight, g/mol:	436.272593
ΔH_f, kcal/mol:	-116.31
Dipole, Da:	5.55
IP(EA), eV:	-9.37(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(furan-2-yl)-2-oxoethyl]-2,6,6-trimethyl-N-phenylbicyclo[3.1.1]heptane-3-carboxamide

Drug info:

PubChemData

Smile

CC1C(CC2CC1C2(C)C)C(=O)N(C3=CC=CC=C3)C(C4=CC=CO4)C(=O)NC(C)(C)CC(C)(C)C

DOS

IR

Vibrations