Geometry & MOs

Info

ID:	148318
PubChem CID:	53787980
Reduced:	N2O7C25H34 (1)
Stoich.:	A2B7C25D34 (1)
Weight, g/mol:	330.230728
ΔH_f, kcal/mol:	-285.71
Dipole, Da:	6.35
IP(EA), eV:	-8.93(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 7-benzyl-2-methyl-3,7-diazabicyclo[3.3.1]nonane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OCCCN3CCCC3)OC(=O)N

DOS

IR

Vibrations