Geometry & MOs

Info

ID:	77017
PubChem CID:	48425711
Reduced:	O3N4C19H26 (1)
Stoich.:	A3B4C19D26 (1)
Weight, g/mol:	335.184506
ΔH_f, kcal/mol:	-50.52
Dipole, Da:	7.61
IP(EA), eV:	-9.87(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[3-[[2-(diethylamino)-2-oxoethyl]amino]-3-oxopropyl]carbamate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC(=NC2=C1C(=NO2)C(C)C)C3CC3

DOS

IR

Vibrations