Geometry & MOs

Info

ID:	220650
PubChem CID:	85201030
Reduced:	O6C29H42 (1)
Stoich.:	A6B29C42 (1)
Weight, g/mol:	486.352969
ΔH_f, kcal/mol:	-269.86
Dipole, Da:	5.11
IP(EA), eV:	-9.6(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[5-[[amino(nitramido)methylidene]amino]-1-(dodecylamino)-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C(=C)CCC(C)C1CCC2C1(CC(C34C2=CCC5C3(C4)C(=O)CC(C5(C(=O)O)O)O)O)C

DOS

IR

Vibrations