Geometry & MOs

Info

ID:	369440
PubChem CID:	127333386
Reduced:	N3O4C17H23 (1)
Stoich.:	A3B4C17D23 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-159.42
Dipole, Da:	3.0
IP(EA), eV:	-8.86(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycycloheptyl)methyl]-3-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

C1CN(C[C@H]1O)C(=O)NC2=CC=C(C=C2)CC(=O)N3CCOCC3

DOS

IR

Vibrations