Geometry & MOs

Info

ID:	398636
PubChem CID:	135034474
Reduced:	NSSiO4C28H45 (1)
Stoich.:	ABCD4E28F45 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-227.73
Dipole, Da:	6.65
IP(EA), eV:	-8.99(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(Z)-7-oxohept-5-enyl]carbamate

Drug info:

PubChemData

Smile

CC1CC(C2(CC(CN=C2C1)O[Si](C(C)C)(C(C)C)C(C)C)S(=O)(=O)C3=CC=CC=C3)CC(=O)C

DOS

IR

Vibrations