Geometry & MOs

Info

ID:	363614
PubChem CID:	127311693
Reduced:	S2O3N4C13H26 (1)
Stoich.:	A2B3C4D13E26 (1)
Weight, g/mol:	255.194677
ΔH_f, kcal/mol:	-146.03
Dipole, Da:	2.95
IP(EA), eV:	-8.49(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[cyclopropyl(methyl)amino]ethyl]-3-(oxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)NC(=O)NCCN2CCSCC2

DOS

IR

Vibrations