Geometry & MOs

Info

ID:	210662
PubChem CID:	80836760
Reduced:	N5C16H27 (1)
Stoich.:	A5B16C27 (1)
Weight, g/mol:	294.205576
ΔH_f, kcal/mol:	23.8
Dipole, Da:	2.71
IP(EA), eV:	-7.98(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-ethyl-2-N-(2-methylbutyl)-3-nitro-6-N-propylpyridine-2,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=CN2C=CN=C2C(=N1)N(CC)CC(C)CC

DOS

IR

Vibrations