Geometry & MOs

Info

ID:	180763
PubChem CID:	76682728
Reduced:	SN4O7C29H32 (1)
Stoich.:	AB4C7D29E32 (1)
Weight, g/mol:	401.270983
ΔH_f, kcal/mol:	-223.62
Dipole, Da:	17.28
IP(EA), eV:	-8.53(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(N'-hydroxycarbamimidoyl)cyclopentyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CC1C2C(C(=O)N2C(=C1SC3CC(N(C3)CC4=CC=C(C=C4)N)C(=O)NC5=CC=CC(=C5)C(=O)O)C(=O)O)C(C)O

DOS

IR

Vibrations