Geometry & MOs

Info

ID:	57013
PubChem CID:	22395220
Reduced:	N5O10C19H27 (1)
Stoich.:	A5B10C19D27 (1)
Weight, g/mol:	256.099685
ΔH_f, kcal/mol:	-392.24
Dipole, Da:	5.25
IP(EA), eV:	-9.1(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dichloromethane;oxane

Drug info:

PubChemData

Smile

CC(C)C(=O)OC1C(C(OC1N2C(=O)C3=C(N=C2N)N(C=N3)C4C(C(C(O4)CO)O)O)CO)O

DOS

IR

Vibrations