Geometry & MOs

Info

ID:	46126
PubChem CID:	10522232
Reduced:	NO2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	356.231122
ΔH_f, kcal/mol:	-122.22
Dipole, Da:	6.06
IP(EA), eV:	-9.55(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-4-methyl-2-[(3S,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxa-2-azaspiro[2.5]octan-2-yl]pentanoate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)C(=O)N(CC)CC

DOS

IR

Vibrations