Geometry & MOs

Info

ID:	437885
PubChem CID:	135227224
Reduced:	N3O6C32H55 (1)
Stoich.:	A3B6C32D55 (1)
Weight, g/mol:	337.225308
ΔH_f, kcal/mol:	-356.18
Dipole, Da:	7.16
IP(EA), eV:	-9.37(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-O-tert-butyl 8-O-methyl (6R,8S)-11,11-dimethyl-9-azadispiro[3.1.46.14]undecane-8,9-dicarboxylate

Drug info:

PubChemData

Smile

CC1(CCCC[C@@]12C[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)[C@H](C3CCCCC3)NC(=O)OC(C)(C)C)C(=O)OC)C

DOS

IR

Vibrations