Geometry & MOs

Info

ID:	43722
PubChem CID:	10321697
Reduced:	O2N3C28H43 (1)
Stoich.:	A2B3C28D43 (1)
Weight, g/mol:	453.270151
ΔH_f, kcal/mol:	-111.88
Dipole, Da:	2.05
IP(EA), eV:	-9.15(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R,1S,2R,3S,4R)-N-[(1S)-2,2-dimethyl-1-phenylpropyl]-4,7,7-trimethyl-3-phenylmethoxybicyclo[2.2.1]heptane-2-sulfinamide

Drug info:

PubChemData

Smile

CC(C)[C@@]1(CC[C@H](C1)NC2CCOCC2)C(=O)N3CCC4=C(C3)C=C(C=N4)C5CCCCC5

DOS

IR

Vibrations