Geometry & MOs

Info

ID:	211138
PubChem CID:	80901695
Reduced:	O3N5C13H21 (1)
Stoich.:	A3B5C13D21 (1)
Weight, g/mol:	294.216809
ΔH_f, kcal/mol:	-38.74
Dipole, Da:	3.11
IP(EA), eV:	-8.65(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-3-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]propanamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CCNC1=C(C(=CC=C1)NN)[N+](=O)[O-]

DOS

IR

Vibrations