Geometry & MOs

Info

ID:	335626
PubChem CID:	127254488
Reduced:	O3N5C24H27 (1)
Stoich.:	A3B5C24D27 (1)
Weight, g/mol:	365.173942
ΔH_f, kcal/mol:	-55.74
Dipole, Da:	2.94
IP(EA), eV:	-8.79(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(1-propan-2-ylindol-4-yl)urea

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC(C)C)NC(=O)C[C@H]3C(=O)NC4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations