Geometry & MOs

Info

ID:	276268
PubChem CID:	103821848
Reduced:	N3O4C15H21 (1)
Stoich.:	A3B4C15D21 (1)
Weight, g/mol:	308.184841
ΔH_f, kcal/mol:	-168.25
Dipole, Da:	7.83
IP(EA), eV:	-8.54(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[3-(carbamoylamino)anilino]propyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCNC1=CC2=C(C=C1)OC(=O)N2

DOS

IR

Vibrations