Geometry & MOs

Info

ID:	368993
PubChem CID:	127331097
Reduced:	O2N5C15H25 (1)
Stoich.:	A2B5C15D25 (1)
Weight, g/mol:	379.229348
ΔH_f, kcal/mol:	-78.53
Dipole, Da:	4.4
IP(EA), eV:	-9.09(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycycloheptyl)methyl]-3-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]urea

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CCNC(=O)NCC(=O)NC2CCCCC2

DOS

IR

Vibrations