Geometry & MOs

Info

ID:	398081
PubChem CID:	135031643
Reduced:	NSiO2C19H33 (1)
Stoich.:	ABC2D19E33 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	-160.41
Dipole, Da:	3.26
IP(EA), eV:	-8.74(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-9-nitro-3-phenyl-2,4,5,7-tetrahydro-1H-pyrrolo[1,2-a][1,3,5]triazepin-8-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCCCC(=O)NCCC1=CC=CC=C1

DOS

IR

Vibrations