Geometry & MOs

Info

ID:	345360
PubChem CID:	127269660
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	380.221226
ΔH_f, kcal/mol:	-87.07
Dipole, Da:	6.24
IP(EA), eV:	-8.3(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(3,4-dihydro-2H-chromen-6-yl)urea

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)NC(=O)NC3CC4=CC=CC=C4OC3)OC1

DOS

IR

Vibrations