Geometry & MOs

Info

ID:	371069
PubChem CID:	127342269
Reduced:	SN3O4C12H21 (1)
Stoich.:	AB3C4D12E21 (1)
Weight, g/mol:	265.179027
ΔH_f, kcal/mol:	-175.78
Dipole, Da:	6.0
IP(EA), eV:	-9.8(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bicyclo[2.2.1]heptanyl)-3-(2-oxoazepan-3-yl)urea

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)C(=O)NC2CCCCNC2=O

DOS

IR

Vibrations