Geometry & MOs

Info

ID:	329038
PubChem CID:	126730749
Reduced:	NO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	412.232185
ΔH_f, kcal/mol:	-33.04
Dipole, Da:	3.56
IP(EA), eV:	-9.28(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(2-methylprop-2-enoyl)amino]ethyl N-[3-[2-[methyl(2-methylprop-2-enoyl)amino]ethoxycarbonylamino]propyl]carbamate

Drug info:

PubChemData

Smile

CC(=C)C(=O)N(C)CCOC1CC2CC1C3C2C=CC3

DOS

IR

Vibrations