Geometry & MOs

Info

ID:	406676
PubChem CID:	135078321
Reduced:	N3O38C56H93 (1)
Stoich.:	A3B38C56D93 (1)
Weight, g/mol:	201.94908
ΔH_f, kcal/mol:	-1731.85
Dipole, Da:	12.56
IP(EA), eV:	-10.0(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

iodomethylperoxyethane

Drug info:

Smile

CC1=NC2C(C(C(OC2O1)CO)OC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)OC6CC(C(C(C6O)O)O)CO)O)NC(=O)C)O)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)OC9CC(C(C(C9O)O)O)CO)O)NC(=O)C)O)O

DOS

IR

Vibrations