Geometry & MOs

Info

ID:	351000
PubChem CID:	127279437
Reduced:	O2N7C16H23 (1)
Stoich.:	A2B7C16D23 (1)
Weight, g/mol:	375.215806
ΔH_f, kcal/mol:	10.9
Dipole, Da:	10.82
IP(EA), eV:	-9.13(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylurea

Drug info:

PubChemData

Smile

CC1(COCCN1CCNC(=O)NC2=CC=C(C=C2)N3C=NN=N3)C

DOS

IR

Vibrations