Geometry & MOs

Info

ID:	314052
PubChem CID:	126620125
Reduced:	BrSN2O3H15C17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-50.61
Dipole, Da:	9.35
IP(EA), eV:	-9.19(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(3-pyridin-4-yloxycyclobutyl)carbamate

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=O)C(NC(=C12)C3=CC=C(C=C3)Br)CC(=O)O)C

DOS

IR

Vibrations