Geometry & MOs

Info

ID:	427026
PubChem CID:	135155116
Reduced:	SO2N6C25H32 (1)
Stoich.:	AB2C6D25E32 (1)
Weight, g/mol:	284.148455
ΔH_f, kcal/mol:	-17.29
Dipole, Da:	6.42
IP(EA), eV:	-8.18(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-diaminohexanoic acid;N-phenylnitramide

Drug info:

PubChemData

Smile

CC(C)[C@H]1COC(=O)N1C2=NC(=NC3=C2SC=C3)NCCC4=CC=C(C=C4)CN5CCNCC5

DOS

IR

Vibrations