Geometry & MOs

Info

ID:	151293
PubChem CID:	53801005
Reduced:	N2O5C10H18 (1)
Stoich.:	A2B5C10D18 (1)
Weight, g/mol:	345.168856
ΔH_f, kcal/mol:	-233.14
Dipole, Da:	3.52
IP(EA), eV:	-9.3(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,1-N-bis(2-methoxyethyl)-3-(3-nitrophenyl)benzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1CNC(=O)N(C1)[C@H]2[C@@H]([C@H]([C@H](O2)CO)O)O

DOS

IR

Vibrations