Geometry & MOs

Info

ID:	340902
PubChem CID:	127263337
Reduced:	N5O16C64H101 (1)
Stoich.:	A5B16C64D101 (1)
Weight, g/mol:	149.060742
ΔH_f, kcal/mol:	-803.82
Dipole, Da:	13.13
IP(EA), eV:	-8.86(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azabicyclo[3.1.0]hexan-5-ylmethanol;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CCCCCCCCCCCCCCCCC(=O)NC(CCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCCCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C(=O)OC(C)(C)C

DOS

IR

Vibrations