Geometry & MOs

Info

ID:	289437
PubChem CID:	104353777
Reduced:	ON5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	295.128054
ΔH_f, kcal/mol:	-7.24
Dipole, Da:	4.39
IP(EA), eV:	-9.15(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(3-hydrazinyl-2-nitrophenyl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(=O)NC1CCN(C1)C2=NC(=NC(=C2)N)C3CC3

DOS

IR

Vibrations