Geometry & MOs

Info

ID:	65271
PubChem CID:	29211860
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	307.225977
ΔH_f, kcal/mol:	-23.36
Dipole, Da:	4.11
IP(EA), eV:	-8.5(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-acetamido-3-methyl-N-[(Z)-[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]amino]butanamide

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=N1)[C@H]2CCCN(C2)CC3=CC=C(O3)COC

DOS

IR

Vibrations