Geometry & MOs

Info

ID:	146202
PubChem CID:	53650048
Reduced:	N2O5C24H30 (1)
Stoich.:	A2B5C24D30 (1)
Weight, g/mol:	281.12949
ΔH_f, kcal/mol:	-192.6
Dipole, Da:	3.7
IP(EA), eV:	-9.13(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(2-chloro-6-methylphenyl)-4-oxohexyl]guanidine

Drug info:

PubChemData

Smile

CC(C)C(=O)N([C@H](CC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations